N-[5-[(3-ethoxypyridin-2-yl)methylamino]-4-(1H-imidazol-2-ylmethylamino)-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-pentan-2-yl]-N-methyl-benzamide

Systemtic Name: N-[5-[(3-ethoxypyridin-2-yl)methylamino]-4-(1H-imidazol-2-ylmethylamino)-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-pentan-2-yl]-N-methyl-benzamide Openeye Name: N-[4-[(3-ethoxy-2-pyridyl)methylamino]-3-(1H-imidazol-2-ylmethylamino)-1-[1-(1-naphthyl)ethylcarbamoyl]butyl]-N-methyl-benzamide CAS Name: N-[5-[(3-ethoxy-2-pyridinyl)methylamino]-4-(1H-imidazol-2-ylmethylamino)-1-[1-(1-naphthalenyl)ethylamino]-1-oxopentan-2-yl]-N-methylbenzamide IUPAC Name: N-[5-[(3-ethoxypyridin-2-yl)methylamino]-4-(1H-imidazol-2-ylmethylamino)-1-(1-naphthalen-1-ylethylamino)-1-oxopentan-2-yl]-N-methylbenzamide Traditional Name: N-[4-[(3-ethoxy-2-pyridyl)methylamino]-3-(1H-imidazol-2-ylmethylamino)-1-[1-(1-naphthyl)ethylcarbamoyl]butyl]-N-methyl-benzamide Formula: C37H43N7O3 MolecularWeight: 633.78242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(N=CC=C1)CNCC(CC(C(=O)NC(C)C2=CC=CC3=CC=CC=C32)N(C)C(=O)C4=CC=CC=C4)NCC5=NC=CN5

Isomeric SMILES

CCOC1=C(N=CC=C1)CNCC(CC(C(=O)NC(C)C2=CC=CC3=CC=CC=C32)N(C)C(=O)C4=CC=CC=C4)NCC5=NC=CN5

InChI

InChI=1S/C37H43N7O3/c1-4-47-34-18-11-19-39-32(34)24-38-23-29(42-25-35-40-20-21-41-35)22-33(44(3)37(46)28-13-6-5-7-14-28)36(45)43-26(2)30-17-10-15-27-12-8-9-16-31(27)30/h5-21,26,29,33,38,42H,4,22-25H2,1-3H3,(H,40,41)(H,43,45)